Vitas-M small molecule compound
(5Z)-2,6-dihydroxy-5-{1-[(3-hydroxypropyl)amino]ethylidene}pyrimidin-4(5H)-one
Catalog ID
STK570580
SMILES OCCCN/C(=C\1/C(=NC(=NC1=O)O)O)/C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C9H13N3O4 MW 227.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H13N3O4/c1-5(10-3-2-4-13)6-7(14)11-9(16)12-8(6)15/h10,13H,2-4H2,1H3,(H2,11,12,14,15,16)InChIKey
CLIQGOWGELUMNY-UHFFFAOYSA-NSynonyms
(5Z)26dihydroxy5(1((3hydroxypropyl)amino)ethylidene)pyrimidin4(5H)one
5(1(3HYDROXYPROPYLAMINO)ETHYLIDENE)13DIAZINANE246TRIONE
5(1(3HYDROXYPROPYLAMINO)ETHYLIDENE)PYRIMIDINE246TRIONE
CC(=C1C(=O)NC(=O)NC1=O)NCCCO
InChI=1SC9H13N3O4c15(1032413)67(14)119(16)128(6)15h1013H24H21H3(H21112141516)
MFCD05731913
OCCCNC(=C1C(=NC(=NC1=O)O)O)C
ZINC000095549036
ZINC08554091
ZINC95549036
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